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pyrido[2,3-d]pyrimidin-4(1H)-one, 7-(4-hydroxyphenyl)-2-mercapto-1-[(tetrahydro-2-furanyl)methyl]-5-(trifluoromethyl)-
SpectraBase Compound ID 2THWo2mjPIw
InChI InChI=1S/C19H16F3N3O3S/c20-19(21,22)13-8-14(10-3-5-11(26)6-4-10)23-16-15(13)17(27)24-18(29)25(16)9-12-2-1-7-28-12/h3-6,8,12,26H,1-2,7,9H2,(H,24,27,29)
InChIKey SEBSPTRDPHFDEW-UHFFFAOYSA-N
Mol Weight 423.41 g/mol
Molecular Formula C19H16F3N3O3S
Exact Mass 423.086447 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID E85GkoPPOww
Name pyrido[2,3-d]pyrimidin-4(1H)-one, 7-(4-hydroxyphenyl)-2-mercapto-1-[(tetrahydro-2-furanyl)methyl]-5-(trifluoromethyl)-
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C19H16F3N3O3S/c20-19(21,22)13-8-14(10-3-5-11(26)6-4-10)23-16-15(13)17(27)24-18(29)25(16)9-12-2-1-7-28-12/h3-6,8,12,26H,1-2,7,9H2,(H,24,27,29)
InChIKey SEBSPTRDPHFDEW-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_23237
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: 2278159; UZI_ID: UZI-023245
Temperature 308 °C